COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK514860
Chemical Name: (5Z)-5-({3-[4-(benzyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-4-methyl-2,6-dioxo-1-pentyl-1,2,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCCCCN1C(=O)/C(=C\c2cn(nc2c2ccc(cc2)OCc2ccccc2)c2ccccc2)/C(=C(C1=O)C#N)C

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Molecular Weight: 556.66
Empirical Formula: C35H32N4O3

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 8.126
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 88
Number of rings: 5

     

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